CID 43655004

(2-amino-1-cyclopropylethyl)(benzyl)methylamine

Structural Information

Molecular Formula
C13H20N2
SMILES
CN(CC1=CC=CC=C1)C(CN)C2CC2
InChI
InChI=1S/C13H20N2/c1-15(13(9-14)12-7-8-12)10-11-5-3-2-4-6-11/h2-6,12-13H,7-10,14H2,1H3
InChIKey
WUZZCDOBFVDZCJ-UHFFFAOYSA-N
Compound name
N-benzyl-1-cyclopropyl-N-methylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.16264 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.169916 143.7
[M+Na]+ 227.151858 149.6
[M-H]- 203.155364 151.5
[M+NH4]+ 222.196463 157.6
[M+K]+ 243.125798 147.2
[M+H-H2O]+ 187.159900 136.2
[M+HCOO]- 249.160841 168.7
[M+CH3COO]- 263.176491 197.9
[M+Na-2H]- 225.137306 148.4
[M]+ 204.16209142 144.5
[M]- 204.16318858 144.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.